input word = C00057130

Metabolite InformationStructural formula
Name Quasipanaxadiol
Formula C30H50O2
Mw 442.38108084
CAS RN 166241-39-0
C_ID C00057130
InChIKey OURRZLJECNEIMI-PHSJGONNSA-N
InChICode InChI=1S/C30H50O2/c1-19(2)10-9-11-20(3)21-12-16-30(8)26(21)22(31)18-24-28(6)15-14-25(32)27(4,5)23(28)13-17-29(24,30)7/h10-11,21-26,31-32H,9,12-18H2,1-8H3/b20-11+/t21-,22-,23+,24-,25+,26+,28+,29-,30-/m1/s1
SMILES CC(C)=CC/C=C(C)[C@H]1CC[C@]2(C)[C@@H]1[C@H](O)C[C@@H]1[C@@]3(C)CC[C@H](O)C(C)(C)[C@@H]3CC[C@]12C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAraliaceaePanax sp. Ref.
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